%chk=000089916.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089916

0 1
 Br  -5.679000      -2.773800       1.123800    
 Br  -5.085000       2.864800      -1.215100    
 O    1.016800     -0.5366000      0.1736000    
 O    7.246300     -0.1721000      0.1398000    
 O    1.169700       1.716700     -0.4072000    
 N   -4.518100     -2.7500000E-02 -2.4000001E-03
 C   -5.299100     -0.8186000     -0.9326000    
 C   -5.196800      0.9083000      0.8717000    
 C   -3.114400     -0.1570000      4.1999999E-02
 C   -2.430400      7.5199999E-02   1.235200    
 C   -2.410100     -0.5166000      -1.107100    
 C   -5.107000      -2.301400     -0.6792000    
 C   -4.721400       2.326700      0.6230000    
 C  -0.3741000     -0.4086000      0.1292000    
 C   -1.042000     -5.2200001E-02   1.279400    
 C   -1.021700     -0.6442000      -1.062700    
 C    3.143600      0.4279000     -5.1800001E-02
 C    1.706000      0.6384000     -0.1173000    
 C    3.986800       1.482000      0.2993000    
 C    3.679100     -0.8278000     -0.3390000    
 C    5.901100      2.5100000E-02  7.5800002E-02
 C    5.365600       1.280600      0.3630000    
 C    5.057900      -1.029100     -0.2752000    
 C    7.726100      -1.480400     -0.1663000    
 H   -5.046800     -0.5717000      -1.970100    
 H   -6.367000     -0.5828000     -0.8397000    
 H   -5.057700      0.6374000       1.924500    
 H   -6.282300      0.8689000      0.7135000    
 H   -2.939600      0.3384000       2.156900    
 H   -2.899000     -0.6879000      -2.060800    
 H   -4.075700      -2.647600     -0.7736000    
 H   -5.731900      -2.892100      -1.355400    
 H   -3.651800       2.479700      0.7810000    
 H   -5.267600       3.033100       1.255000    
 H  -0.5093000      0.1237000       2.208700    
 H  -0.4724000     -0.9207000      -1.957300    
 H    3.585800       2.465700      0.5293000    
 H    3.048400      -1.664400     -0.6283000    
 H    6.017500       2.105200      0.6380000    
 H    5.407000      -2.028100     -0.5131000    
 H    8.816200      -1.456600     -6.5800004E-02
 H    7.355400      -2.222500      0.5489000    
 H    7.506800      -1.757200      -1.203100    


%chk=000089916-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089916

0 1
Br -6.518037 -2.440170 1.535134
Br -6.315390 2.227987 -1.953774
O 1.114645 -0.107683 0.113696
O 7.514891 -0.385829 -0.114452
O 1.625010 1.480352 1.777870
N -4.577882 -0.074747 -0.076356
C -5.277171 -1.131317 -0.817291
C -5.380990 0.974384 0.563665
C -3.168523 -0.057646 0.002354
C -2.473140 0.905344 0.796603
C -2.369179 -1.005786 -0.712072
C -5.320047 -2.494905 -0.107637
C -5.362154 2.331450 -0.159743
C -0.308603 -0.016734 0.161478
C -1.066946 0.932193 0.885116
C -0.966715 -0.978817 -0.633902
C 3.409304 0.322329 0.594326
C 1.997391 0.647224 0.914726
C 4.429566 0.981514 1.337866
C 3.779809 -0.602256 -0.414624
C 6.141636 -0.203665 0.064691
C 5.781781 0.723174 1.079586
C 5.136379 -0.869345 -0.685455
C 7.953485 -1.326466 -1.151556
H -4.801788 -1.285024 -1.809768
H -6.303938 -0.792426 -1.031155
H -5.032134 1.145730 1.604385
H -6.419929 0.617268 0.653314
H -3.022523 1.653428 1.374737
H -2.831027 -1.768333 -1.344722
H -4.338477 -2.807805 0.276946
H -5.759548 -3.274653 -0.750017
H -4.346051 2.671427 -0.406677
H -5.909138 3.102156 0.406317
H -0.570568 1.673251 1.511978
H -0.367135 -1.705965 -1.190285
H 4.133296 1.694021 2.114327
H 2.996897 -1.107364 -0.986317
H 6.578079 1.220002 1.641245
H 5.397776 -1.584843 -1.470469
H 9.051957 -1.301398 -1.113204
H 7.594725 -2.351803 -0.939299
H 7.606305 -1.007956 -2.153084


